(Q105150675)

English

(5R,10R,13R,14S,17R)-4,4,10,13,14-pentamethyl-17-[(E,2S)-6-methylhept-3-en-2-yl]-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

lanostane triterpenoid

0 references

mass

424.370516156 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(5R,10R,13R,14S,17R)-4,4,10,13,14-pentamethyl-17-[(2S)-6-methylhept-3-en-2-yl]-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one

1 reference

based on heuristic

inferred from InChIKey

chemical formula

C₃₀H₄₈O

0 references

canonical SMILES

O=C1CCC2(C3=C(CCC2C1(C)C)C4(C)CCC(C(C=CCC(C)C)C)C4(C)CC3)C

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isomeric SMILES

CC(C)C/C=C/[C@H](C)[C@H]1CC[C@]2(C)C3=C(CC[C@]12C)[C@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3

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found in taxon

Canscora alata

1 reference

stated in

Lanostane triterpenes of Canscora decussata

Identifiers

InChI

InChI=1S/C30H48O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h9,11,20-22,25H,10,12-19H2,1-8H3/b11-9+/t21-,22+,25-,28-,29+,30+/m0/s1

0 references

InChIKey

LENYQUOTRXGYQY-VCPJHCIESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LENYQUOTRXGYQY-VCPJHCIESA-N

(Q105150675)

(5R,10R,13R,14S,17R)-4,4,10,13,14-pentamethyl-17-[(E,2S)-6-methylhept-3-en-2-yl]-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one

Statements

Identifiers

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