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Substance Name: Calocinin
RN: 116965-72-1
InChIKey: OONXNTUZEDPBLV-NBEUKELOSA-N

Molecular Formula

  • C27-H44-O6

Molecular Weight

  • 464.639
 
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Names and Synonyms

Results Name

  • Calocinin

Synonym

  • Calocinin

Systematic Name

  • beta-L-lyxo-Hexopyranoside, (3beta,14beta)-14,20-dihydroxypregn-5-en-3-yl 2,6-dideoxy-

Registry Numbers

CAS Registry Number

  • 116965-72-1

System Generated Number

  • 0116965721

Structure Descriptors

InChI

1S/C27H44O6/c1-15(28)19-9-12-27(31)21-6-5-17-13-18(33-23-14-22(29)24(30)16(2)32-23)7-10-25(17,3)20(21)8-11-26(19,27)4/h5,15-16,18-24,28-31H,6-14H2,1-4H3/t15?,16-,18?,19+,20?,21?,22+,23-,24+,25-,26+,27-/m0/s1

InChIKey

OONXNTUZEDPBLV-NBEUKELOSA-N

Smiles

O([C@H]1C[C@@H](O)[C@H](O)[C@@H](O1)C)[C@@H]1CC[C@@]2([C@@H]3CC[C@@]4([C@H](CC[C@@]4([C@@H]3CC=C2C1)O)[C@@H](C)O)C)C