Summary

Molecular formula: C30H46O6
SMILES: CC(C(=C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C(=O)C1=C2[C@H](O)C[C@@H]2[C@]1(C)CC[C@H](C2(C)C)O)C)C(=O)O
InChI: InChI=1S/C30H46O6/c1-15(17(3)27(35)36)8-9-16(2)18-10-11-19-23-20(31)14-21-28(4,5)22(32)12-13-29(21,6)24(23)25(33)26(34)30(18,19)7/h16-22,26,31-32,34H,1,8-14H2,2-7H3,(H,35,36)/t16-,17?,18-,19+,20-,21+,22-,26+,29+,30-/m1/s1
InChIKey: PXHAVGLEZMKZBW-CTYLRPOHSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC2CCCC2C2=C1C1CCCCC1CC2

Scaffold Graph/Node level:
OC1CC2CCCC2C2CCC3CCCCC3C12

Scaffold Graph level:
CC1CC2CCCC2C2CCC3CCCCC3C12

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Steroids and steroid derivatives
Sub class: Bile acids, alcohols and derivatives

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Synonymous chemical names:
methyl antcinate l

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Chemical structure download