(Q105281951)

English

[(4aR,6aR,6aR,6bR,8aS,9R,12aR,14aS,14bR)-2,2,4a,6a,8a,9,14a-heptamethyl-10-oxo-3,4,5,6,6b,7,8,9,11,12,12a,13,14,14b-tetradecahydro-1H-picen-6a-yl]methyl acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(2,2,4a,6a,8a,9,14a-heptamethyl-10-oxo-3,4,5,6,6b,7,8,9,11,12,12a,13,14,14b-tetradecahydro-1H-picen-6a-yl)methyl acetate

1 reference

based on heuristic

inferred from SMILES

mass

484.391645524 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₅₂O₃

0 references

canonical SMILES

O=C(OCC12CCC3(C)C4CC(C)(C)CCC4(C)CCC3(C)C2CCC5(C)C(C(=O)CCC51)C)C

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isomeric SMILES

CC(=O)OC[C@@]12CC[C@@]3(C)[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@]3(C)[C@H]1CC[C@]1(C)[C@@H](C)C(=O)CC[C@H]12

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found in taxon

Elaeodendron glaucum

1 reference

stated in

Elaeodendrol and elaeodendradiol, new nor-triterpenes from Elaeodendron glaucum

Identifiers

InChI

InChI=1S/C32H52O3/c1-21-23(34)9-10-24-29(21,6)12-11-25-30(7)16-15-28(5)14-13-27(3,4)19-26(28)31(30,8)17-18-32(24,25)20-35-22(2)33/h21,24-26H,9-20H2,1-8H3/t21-,24+,25+,26+,28+,29+,30+,31-,32+/m0/s1

0 references

InChIKey

UYUPEDGDRRJMRG-MWLCVRSFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UYUPEDGDRRJMRG-MWLCVRSFSA-N

(Q105281951)

[(4aR,6aR,6aR,6bR,8aS,9R,12aR,14aS,14bR)-2,2,4a,6a,8a,9,14a-heptamethyl-10-oxo-3,4,5,6,6b,7,8,9,11,12,12a,13,14,14b-tetradecahydro-1H-picen-6a-yl]methyl acetate

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Identifiers

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