Showing NP-Card for Noonindole G (NP0331481)
Record Information | ||||||||||||||||
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Version | 2.0 | |||||||||||||||
Created at | 2023-02-01 04:00:48 UTC | |||||||||||||||
Updated at | 2024-09-03 04:15:52 UTC | |||||||||||||||
NP-MRD ID | NP0331481 | |||||||||||||||
Natural Product DOI | https://doi.org/10.57994/0435 | |||||||||||||||
Secondary Accession Numbers | None | |||||||||||||||
Natural Product Identification | ||||||||||||||||
Common Name | Noonindole G | |||||||||||||||
Description | Noonindole G was first documented in 2023 (PMID: 36662567). | |||||||||||||||
Structure | MOL for NP0331481 (Noonindole G)Mrv1652302012305002D 46 52 0 0 1 0 999 V2000 3.4402 0.7048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4433 -0.1202 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3601 -0.9410 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1126 -0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5538 -1.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1957 0.2182 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2789 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0313 1.3773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7005 0.8949 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4530 1.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1222 0.7509 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7915 0.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8746 1.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2130 0.3368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 1.4276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2963 0.9452 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0487 1.2836 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1319 2.1044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7179 0.8012 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4704 1.1396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6348 -0.0196 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3040 -0.5020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8824 -0.3580 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7992 -1.1788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0468 -1.5172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2131 0.1244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5362 1.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3698 0.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6174 0.0741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2866 -0.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -0.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7083 -0.5523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7083 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 -0.2643 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9481 0.5565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7818 -1.0851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0294 -1.4234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6884 0.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1386 -0.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3837 -0.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6313 -0.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0379 0.0741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0452 0.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7976 1.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4669 0.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2732 0.9254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 3 4 1 6 0 0 0 3 5 1 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 6 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 15 1 1 0 0 0 16 17 1 0 0 0 0 17 18 1 1 0 0 0 17 19 1 0 0 0 0 19 20 1 1 0 0 0 19 21 1 0 0 0 0 21 22 1 6 0 0 0 21 23 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 0 0 0 0 23 26 1 0 0 0 0 16 26 1 0 0 0 0 13 27 1 0 0 0 0 9 28 1 1 0 0 0 9 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 11 31 1 0 0 0 0 31 32 2 0 0 0 0 6 33 1 6 0 0 0 6 34 1 0 0 0 0 29 34 1 0 0 0 0 34 35 1 1 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 3 37 1 0 0 0 0 2 38 1 0 0 0 0 38 39 2 0 0 0 0 5 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 40 45 1 0 0 0 0 45 46 1 0 0 0 0 38 46 1 0 0 0 0 M END 3D SDF for NP0331481 (Noonindole G)Mrv1652302012305002D 46 52 0 0 1 0 999 V2000 3.4402 0.7048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4433 -0.1202 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3601 -0.9410 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1126 -0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5538 -1.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1957 0.2182 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2789 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0313 1.3773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7005 0.8949 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4530 1.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1222 0.7509 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7915 0.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8746 1.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2130 0.3368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 1.4276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2963 0.9452 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0487 1.2836 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1319 2.1044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7179 0.8012 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4704 1.1396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6348 -0.0196 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3040 -0.5020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8824 -0.3580 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7992 -1.1788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0468 -1.5172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2131 0.1244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5362 1.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3698 0.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6174 0.0741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2866 -0.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -0.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7083 -0.5523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7083 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 -0.2643 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9481 0.5565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7818 -1.0851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0294 -1.4234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6884 0.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1386 -0.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3837 -0.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6313 -0.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0379 0.0741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0452 0.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7976 1.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4669 0.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2732 0.9254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 3 4 1 6 0 0 0 3 5 1 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 6 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 15 1 1 0 0 0 16 17 1 0 0 0 0 17 18 1 1 0 0 0 17 19 1 0 0 0 0 19 20 1 1 0 0 0 19 21 1 0 0 0 0 21 22 1 6 0 0 0 21 23 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 0 0 0 0 23 26 1 0 0 0 0 16 26 1 0 0 0 0 13 27 1 0 0 0 0 9 28 1 1 0 0 0 9 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 11 31 1 0 0 0 0 31 32 2 0 0 0 0 6 33 1 6 0 0 0 6 34 1 0 0 0 0 29 34 1 0 0 0 0 34 35 1 1 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 3 37 1 0 0 0 0 2 38 1 0 0 0 0 38 39 2 0 0 0 0 5 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 40 45 1 0 0 0 0 45 46 1 0 0 0 0 38 46 1 0 0 0 0 M END > <DATABASE_ID> NP0331481 > <DATABASE_NAME> NP-MRD > <SMILES> [H][C@]12CC3=C(NC4=CC=CC=C34)[C@]1(C)[C@@]1(C)CC[C@]3([H])O[C@@]([H])(C(=O)C=C3[C@]1([H])CC2)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O > <INCHI_IDENTIFIER> InChI=1S/C33H43NO8/c1-31(2,42-30-27(39)26(38)25(37)24(15-35)41-30)29-22(36)14-19-20-10-9-16-13-18-17-7-5-6-8-21(17)34-28(18)33(16,4)32(20,3)12-11-23(19)40-29/h5-8,14,16,20,23-27,29-30,34-35,37-39H,9-13,15H2,1-4H3/t16-,20-,23-,24+,25+,26-,27-,29-,30-,32-,33+/m0/s1 > <INCHI_KEY> PCKUUVWOWOYYON-HZLSCRHZSA-N > <FORMULA> C33H43NO8 > <MOLECULAR_WEIGHT> 581.706 > <EXACT_MASS> 581.298867349 > <JCHEM_ACCEPTOR_COUNT> 8 > <JCHEM_ATOM_COUNT> 85 > <JCHEM_AVERAGE_POLARIZABILITY> 64.96759002864049 > <JCHEM_BIOAVAILABILITY> 1 > <JCHEM_DONOR_COUNT> 5 > <JCHEM_FORMAL_CHARGE> 0 > <JCHEM_GHOSE_FILTER> 0 > <JCHEM_IUPAC> (1S,2S,5S,7R,11R,14S)-1,2-dimethyl-7-(2-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-6-oxa-23-azahexacyclo[12.10.0.0^{2,11}.0^{5,10}.0^{16,24}.0^{17,22}]tetracosa-9,16(24),17,19,21-pentaen-8-one > <JCHEM_LOGP> 2.855639919999999 > <JCHEM_MDDR_LIKE_RULE> 0 > <JCHEM_NUMBER_OF_RINGS> 7 > <JCHEM_PHYSIOLOGICAL_CHARGE> 0 > <JCHEM_PKA> 13.199800098993158 > <JCHEM_PKA_STRONGEST_ACIDIC> 12.210032524476642 > <JCHEM_PKA_STRONGEST_BASIC> -2.9810836842609314 > <JCHEM_POLAR_SURFACE_AREA> 141.47 > <JCHEM_REFRACTIVITY> 154.2556999999999 > <JCHEM_ROTATABLE_BOND_COUNT> 4 > <JCHEM_RULE_OF_FIVE> 0 > <JCHEM_TRADITIONAL_IUPAC> (1S,2S,5S,7R,11R,14S)-1,2-dimethyl-7-(2-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-6-oxa-23-azahexacyclo[12.10.0.0^{2,11}.0^{5,10}.0^{16,24}.0^{17,22}]tetracosa-9,16(24),17,19,21-pentaen-8-one > <JCHEM_VEBER_RULE> 0 $$$$ PDB for NP0331481 (Noonindole G)HEADER PROTEIN 01-FEB-23 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-FEB-23 0 HETATM 1 C UNK 0 6.422 1.316 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 6.428 -0.224 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 6.272 -1.757 0.000 0.00 0.00 C+0 HETATM 4 H UNK 0 7.677 -1.125 0.000 0.00 0.00 H+0 HETATM 5 C UNK 0 4.767 -2.082 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 7.832 0.407 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 7.987 1.939 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 9.392 2.571 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 10.641 1.671 0.000 0.00 0.00 C+0 HETATM 10 O UNK 0 12.046 2.302 0.000 0.00 0.00 O+0 HETATM 11 C UNK 0 13.295 1.402 0.000 0.00 0.00 C+0 HETATM 12 H UNK 0 14.544 0.501 0.000 0.00 0.00 H+0 HETATM 13 C UNK 0 14.699 2.033 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 15.331 0.629 0.000 0.00 0.00 C+0 HETATM 15 O UNK 0 16.104 2.665 0.000 0.00 0.00 O+0 HETATM 16 C UNK 0 17.353 1.764 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 18.758 2.396 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 18.913 3.928 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 20.007 1.496 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 21.411 2.127 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 19.852 -0.037 0.000 0.00 0.00 C+0 HETATM 22 O UNK 0 21.101 -0.937 0.000 0.00 0.00 O+0 HETATM 23 C UNK 0 18.447 -0.668 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 18.292 -2.200 0.000 0.00 0.00 C+0 HETATM 25 O UNK 0 16.887 -2.832 0.000 0.00 0.00 O+0 HETATM 26 O UNK 0 17.198 0.232 0.000 0.00 0.00 O+0 HETATM 27 C UNK 0 14.068 3.438 0.000 0.00 0.00 C+0 HETATM 28 H UNK 0 11.890 0.770 0.000 0.00 0.00 H+0 HETATM 29 C UNK 0 10.486 0.138 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 11.735 -0.762 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 13.140 -0.131 0.000 0.00 0.00 C+0 HETATM 32 O UNK 0 14.389 -1.031 0.000 0.00 0.00 O+0 HETATM 33 C UNK 0 6.922 1.650 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 9.081 -0.493 0.000 0.00 0.00 C+0 HETATM 35 H UNK 0 9.237 1.039 0.000 0.00 0.00 H+0 HETATM 36 C UNK 0 8.926 -2.025 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 7.522 -2.657 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 5.018 0.397 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 3.992 -0.752 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 2.583 -0.131 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 1.178 -0.762 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 -0.071 0.138 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 0.084 1.671 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 1.489 2.302 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 2.738 1.402 0.000 0.00 0.00 C+0 HETATM 46 N UNK 0 4.243 1.727 0.000 0.00 0.00 N+0 CONECT 1 2 CONECT 2 1 3 6 38 CONECT 3 2 4 5 37 CONECT 4 3 CONECT 5 3 39 CONECT 6 2 7 33 34 CONECT 7 6 8 CONECT 8 7 9 CONECT 9 8 10 28 29 CONECT 10 9 11 CONECT 11 10 12 13 31 CONECT 12 11 CONECT 13 11 14 15 27 CONECT 14 13 CONECT 15 13 16 CONECT 16 15 17 26 CONECT 17 16 18 19 CONECT 18 17 CONECT 19 17 20 21 CONECT 20 19 CONECT 21 19 22 23 CONECT 22 21 CONECT 23 21 24 26 CONECT 24 23 25 CONECT 25 24 CONECT 26 23 16 CONECT 27 13 CONECT 28 9 CONECT 29 9 30 34 CONECT 30 29 31 CONECT 31 30 11 32 CONECT 32 31 CONECT 33 6 CONECT 34 6 29 35 36 CONECT 35 34 CONECT 36 34 37 CONECT 37 36 3 CONECT 38 2 39 46 CONECT 39 38 5 40 CONECT 40 39 41 45 CONECT 41 40 42 CONECT 42 41 43 CONECT 43 42 44 CONECT 44 43 45 CONECT 45 44 40 46 CONECT 46 45 38 MASTER 0 0 0 0 0 0 0 0 46 0 104 0 END SMILES for NP0331481 (Noonindole G)[H][C@]12CC3=C(NC4=CC=CC=C34)[C@]1(C)[C@@]1(C)CC[C@]3([H])O[C@@]([H])(C(=O)C=C3[C@]1([H])CC2)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O INCHI for NP0331481 (Noonindole G)InChI=1S/C33H43NO8/c1-31(2,42-30-27(39)26(38)25(37)24(15-35)41-30)29-22(36)14-19-20-10-9-16-13-18-17-7-5-6-8-21(17)34-28(18)33(16,4)32(20,3)12-11-23(19)40-29/h5-8,14,16,20,23-27,29-30,34-35,37-39H,9-13,15H2,1-4H3/t16-,20-,23-,24+,25+,26-,27-,29-,30-,32-,33+/m0/s1 3D Structure for NP0331481 (Noonindole G) | |||||||||||||||
Synonyms | Not Available | |||||||||||||||
Chemical Formula | C33H43NO8 | |||||||||||||||
Average Mass | 581.7060 Da | |||||||||||||||
Monoisotopic Mass | 581.29887 Da | |||||||||||||||
IUPAC Name | Not Available | |||||||||||||||
Traditional Name | Not Available | |||||||||||||||
CAS Registry Number | Not Available | |||||||||||||||
SMILES | [H][C@]12CC3=C(NC4=CC=CC=C34)[C@]1(C)[C@@]1(C)CC[C@]3([H])O[C@@]([H])(C(=O)C=C3[C@]1([H])CC2)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O | |||||||||||||||
InChI Identifier | InChI=1S/C33H43NO8/c1-31(2,42-30-27(39)26(38)25(37)24(15-35)41-30)29-22(36)14-19-20-10-9-16-13-18-17-7-5-6-8-21(17)34-28(18)33(16,4)32(20,3)12-11-23(19)40-29/h5-8,14,16,20,23-27,29-30,34-35,37-39H,9-13,15H2,1-4H3/t16-,20-,23-,24+,25+,26-,27-,29-,30-,32-,33+/m0/s1 | |||||||||||||||
InChI Key | PCKUUVWOWOYYON-HZLSCRHZSA-N | |||||||||||||||
Experimental Spectra | ||||||||||||||||
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Predicted Spectra | ||||||||||||||||
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Chemical Taxonomy | ||||||||||||||||
Classification | Not classified | |||||||||||||||
Physical Properties | ||||||||||||||||
State | Not Available | |||||||||||||||
Experimental Properties |
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Predicted Properties |
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External Links | ||||||||||||||||
External Links | Not Available | |||||||||||||||
References | ||||||||||||||||
General References | Not Available |