Summary

Molecular formula: C31H48O4
SMILES: O=C1O[C@]2([C@H]([C@@H]1C)C)C[C@@H](C)[C@@H]1[C@]3([C@H](O2)CC2=C([C@@]3(CC1)C)CC[C@@H]1[C@]2(C)CC[C@H](C1(C)C)O)C
InChI: InChI=1S/C31H48O4/c1-17-16-31(19(3)18(2)26(33)35-31)34-25-15-22-21(29(7)14-11-20(17)30(25,29)8)9-10-23-27(4,5)24(32)12-13-28(22,23)6/h17-20,23-25,32H,9-16H2,1-8H3/t17-,18+,19+,20-,23+,24-,25-,28-,29+,30+,31+/m1/s1
InChIKey: LSGLUPXTGXDHCT-ZBAFWHTDSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCC2(CCC3CCC4C5=C(CC(O2)C34)C2CCCCC2CC5)O1

Scaffold Graph/Node level:
OC1CCC2(CCC3CCC4C5CCC6CCCCC6C5CC(O2)C34)O1

Scaffold Graph level:
CC1CCC2(CCC3CCC4C5CCC6CCCCC6C5CC(C2)C34)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:
fomlactone b

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External chemical identifiers:
CID_11826996; CHEMSPIDER_10001646; ZINC_ZINC000255228314

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Chemical structure download