(Q105310800)

English

(1S,2S,4R,5'R,6R,7R,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

chemical compound

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instance of

type of chemical entity

0 references

1 reference

414.313395204 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,2S,4S,5'S,6R,7S,8R,9S,12R,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,2S,4R,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,2R,4R,5'R,6S,7R,8S,9S,12S,13R,16R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(25R)-spirost-5-en-3alpha-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,2S,4S,5'R,6R,7S,8R,9S,12R,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,2S,4S,5'R,6S,7S,8S,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

1 reference

1 reference

C₂₇H₄₂O₃

0 references

canonical SMILES

OC1CC2=CCC3C(CCC4(C)C3CC5OC6(OCC(C)CC6)C(C)C54)C2(C)CC1

0 references

isomeric SMILES

C[C@@H]1CC[C@@]2(OC1)O[C@@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@H]2C

0 references

found in taxon

Dioscorea tokoro

1 reference

stated in

Steroidal sapogenins and sterols in tissue cultures of dioscorea tokoro

Identifiers

InChI

InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17-,19+,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1

0 references

InChIKey

WQLVFSAGQJTQCK-FWWTVLDCSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WQLVFSAGQJTQCK-FWWTVLDCSA-N

(Q105310800)

(1S,2S,4R,5'R,6R,7R,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

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