(Q105281480)

English

(5Z)-3-methyl-5-[(2S)-2-[(5S,9S,10R,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]propylidene]furan-2-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-Methyl-5-[2-(4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)propylidene]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

450.313395204 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₂O₃

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canonical SMILES

O=C1OC(C=C1C)=CC(C)C2CCC3(C4=CCC5C(C(=O)CCC5(C)C4CCC23C)(C)C)C

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isomeric SMILES

CC1=C/C(=C/[C@@H](C)[C@H]2CC[C@@]3(C)C4=CC[C@@H]5C(C)(C)C(=O)CC[C@]5(C)[C@@H]4CC[C@]23C)OC1=O

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found in taxon

Abies sibirica

1 reference

stated in

Triterpenoids from Abies species VII. New lanostane lactones from Siberian fir needles

Identifiers

InChI

InChI=1S/C30H42O3/c1-18(16-20-17-19(2)26(32)33-20)21-10-14-30(7)23-8-9-24-27(3,4)25(31)12-13-28(24,5)22(23)11-15-29(21,30)6/h8,16-18,21-22,24H,9-15H2,1-7H3/b20-16-/t18-,21-,22-,24-,28-,29-,30+/m1/s1

0 references

InChIKey

UYHPXELOHFWNJE-VIRGIBLWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UYHPXELOHFWNJE-VIRGIBLWSA-N

(Q105281480)

(5Z)-3-methyl-5-[(2S)-2-[(5S,9S,10R,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]propylidene]furan-2-one

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