(Q105141318)

English

(1S,3'R,3aS,5'S,5aR,6S,9aS,11aS)-6-(hydroxymethyl)-3',3a,6,9a,11a-pentamethyl-5'-propanoyl-3,4,5,5a,8,9,10,11-octahydro-2H-spiro[cyclopenta[a]phenanthrene-1,2'-oxolan]-7-one

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

4-(hydroxymethyl)-3',4,10,13,14-pentamethyl-5'-propanoylspiro[2,5,6,7,11,12,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-3-one

1 reference

based on heuristic

inferred from SMILES

mass

456.323959888 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₄₄O₄

0 references

canonical SMILES

O=C(CC)C1OC2(CCC3(C4=C(CCC32C)C5(C)CCC(=O)C(C)(CO)C5CC4)C)C(C)C1

0 references

isomeric SMILES

CCC(=O)[C@@H]1C[C@@H](C)[C@]2(CC[C@@]3(C)C4=C(CC[C@@]32C)[C@@]2(C)CCC(=O)[C@](C)(CO)[C@@H]2CC4)O1

0 references

found in taxon

Barnardia japonica var. japonica

1 reference

stated in

A new homostilbene and two new homoisoflavones from the bulbs of Scilla scilloides

Identifiers

InChI

InChI=1S/C29H44O4/c1-7-21(31)22-16-18(2)29(33-22)15-14-27(5)20-8-9-23-25(3,19(20)10-13-28(27,29)6)12-11-24(32)26(23,4)17-30/h18,22-23,30H,7-17H2,1-6H3/t18-,22+,23-,25-,26-,27+,28+,29+/m1/s1

0 references

InChIKey

KHSHJGYTLGFEMC-LBQQCSDXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KHSHJGYTLGFEMC-LBQQCSDXSA-N

1 reference

(Q105141318)

(1S,3'R,3aS,5'S,5aR,6S,9aS,11aS)-6-(hydroxymethyl)-3',3a,6,9a,11a-pentamethyl-5'-propanoyl-3,4,5,5a,8,9,10,11-octahydro-2H-spiro[cyclopenta[a]phenanthrene-1,2'-oxolan]-7-one

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)