Summary

Molecular formula: C38H54O8
SMILES: COC(=O)C[C@@](CC(=O)O[C@@H]1CC[C@]2([C@H](C1(C)C)CC(=O)C1=C2C=C[C@]2([C@@]1(C)CC[C@@H]2[C@@H](C[C@H]1OC(=O)C(=C1C)C)C)C)C)(O)C
InChI: InChI=1S/C38H54O8/c1-21(17-27-22(2)23(3)33(42)45-27)24-11-16-38(9)32-25(12-15-37(24,38)8)36(7)14-13-29(34(4,5)28(36)18-26(32)39)46-31(41)20-35(6,43)19-30(40)44-10/h12,15,21,24,27-29,43H,11,13-14,16-20H2,1-10H3/t21-,24-,27-,28+,29-,35+,36-,37-,38+/m1/s1
InChIKey: PSXJMKVNDMXDEM-NNNSZHMUSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=CC(CCC2CCC3C4=C(C=CC23)C2CCCCC2CC4=O)O1

Scaffold Graph/Node level:
OC1CCC(CCC2CCC3C2CCC2C4CCCCC4CC(O)C32)O1

Scaffold Graph level:
CC1CCC(CCC2CCC3C2CCC2C4CCCCC4CC(C)C32)C1

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Steroids and steroid derivatives
Sub class: Steroid lactones

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Synonymous chemical names:
palustrisolide g

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External chemical identifiers:
CID_139590977; NPATLAS_NPA023724; CHEMSPIDER_78442195

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Chemical structure download