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(Q104981146)
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English
Methyl 7-acetyloxy-9,12-dihydroxy-5a,5b,8,11a,13b-pentamethyl-3-prop-1-en-2-yl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene-8-carboxylate
group of stereoisomers with the chemical formula C₃₃H₅₂O₆
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Statements
instance of
group of stereoisomers
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subclass of
hopane triterpenoid
1 reference
inferred from
hopane triterpenoid
mass
544.3763893839998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₃H₅₂O₆
0 references
canonical SMILES
O=C(OC1CC2(C)C(C(O)CC3C4(C)CCC(C(=C)C)C4CCC32C)C5(C)CCC(O)C(C(=O)OC)(C)C15)C
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Identifiers
InChI
InChI=1S/C33H52O6/c1-18(2)20-10-13-29(4)21(20)11-15-31(6)24(29)16-22(35)26-30(5)14-12-25(36)33(8,28(37)38-9)27(30)23(39-19(3)34)17-32(26,31)7/h20-27,35-36H,1,10-17H2,2-9H3
0 references
InChIKey
DICJXAYCQPWCBL-UHFFFAOYSA-N
0 references
PubChem CID
162872521
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DICJXAYCQPWCBL-UHFFFAOYSA-N
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