(Q105192595)

English

(2R,4aS,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-2,4a,6a,6a,8a,14a-hexamethyl-9-methylidene-3,4,5,6,6b,7,8,12,12a,13,14,14b-dodecahydro-1H-picene-2-carboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2,4a,6a,6a,8a,14a-hexamethyl-9-methylidene-3,4,5,6,6b,7,8,12,12a,13,14,14b-dodecahydro-1H-picene-2-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

438.349780712 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₆O₂

0 references

canonical SMILES

O=C(O)C1(C)CCC2(C)CCC3(C)C4CCC5(C(=C)C=CCC5C4(C)CCC3(C)C2C1)C

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isomeric SMILES

C=C1C=CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]2(C)CC[C@]2(C)[C@H]3C[C@](C)(C(=O)O)CC[C@]3(C)CC[C@]12C

0 references

found in taxon

Acanthothamnus aphyllus

1 reference

stated in

D: A-friedo-oleanane triterpenes from the roots of Acanthothamnus aphyllus

Identifiers

InChI

InChI=1S/C30H46O2/c1-20-9-8-10-21-27(20,4)12-11-22-28(21,5)16-18-30(7)23-19-26(3,24(31)32)14-13-25(23,2)15-17-29(22,30)6/h8-9,21-23H,1,10-19H2,2-7H3,(H,31,32)/t21-,22-,23+,25-,26-,27-,28+,29-,30-/m1/s1

0 references

InChIKey

OILYITYWDFELBV-WWKVTYGYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OILYITYWDFELBV-WWKVTYGYSA-N

(Q105192595)

(2R,4aS,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-2,4a,6a,6a,8a,14a-hexamethyl-9-methylidene-3,4,5,6,6b,7,8,12,12a,13,14,14b-dodecahydro-1H-picene-2-carboxylic acid

Statements

Identifiers

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