(Q105260263)

English

(4aS,6bR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carbaldehyde

group of stereoisomers with the chemical formula C₃₀H₄₈O₂

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Statements

group of stereoisomers

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oleanane triterpenoid

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oleanane triterpenoid

440.365430776 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₀H₄₈O₂

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canonical SMILES

O=CC12CCC(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC1

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isomeric SMILES

CC1(C)CC[C@]2(C=O)CCC3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)[C@@H]2C1

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Identifiers

InChI=1S/C30H48O2/c1-25(2)14-16-30(19-31)17-15-28(6)20(21(30)18-25)8-9-23-27(5)12-11-24(32)26(3,4)22(27)10-13-29(23,28)7/h8,19,21-24,32H,9-18H2,1-7H3/t21-,22?,23?,24-,27-,28?,29+,30+/m0/s1

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STHRNDDZYFUIDO-KWVOMAKGSA-N

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based on heuristic

inferred from InChIKey

matched by identifier from

STHRNDDZYFUIDO-KWVOMAKGSA-N

UniChem compound ID

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