(Q104994364)

English

(4aS,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydropicene-4a-carboxylic acid

chemical compound

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instance of

type of chemical entity

0 references

subclass of

2,2,6a,6b,9,9,12a-heptamethyl-hexadecahydropicene-4a-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

442.38108084 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₅₀O₂

0 references

canonical SMILES

O=C(O)C12CCC(C)(C)CC2C3CCC4C5(C)CCCC(C)(C)C5CCC4(C)C3(C)CC1

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isomeric SMILES

CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCCC(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1

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found in taxon

Phyllanthus velutinus

1 reference

stated in

Triterpenoids from Glochidion heyneanum*

Identifiers

InChI

InChI=1S/C30H50O2/c1-25(2)15-17-30(24(31)32)18-16-28(6)20(21(30)19-25)9-10-23-27(5)13-8-12-26(3,4)22(27)11-14-29(23,28)7/h20-23H,8-19H2,1-7H3,(H,31,32)/t20-,21+,22+,23-,27+,28-,29-,30+/m1/s1

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InChIKey

FFDHYUFECJTEAY-MRULXVATSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FFDHYUFECJTEAY-MRULXVATSA-N

(Q104994364)

(4aS,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydropicene-4a-carboxylic acid

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Identifiers

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