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Substance Name: EINECS 306-460-1
RN: 97259-96-6
InChIKey: BUPXEHBUWNOSOD-LZDABRNRSA-N

Molecular Formula

  • C26-H40-O6

Molecular Weight

  • 448.596
 
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Names and Synonyms

Results Name

  • EINECS 306-460-1

Synonym

  • EINECS 306-460-1

Systematic Name

  • Sorbitan, mono((1R-(1alpha,4abeta,4balpha,10aalpha))-1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylate)

Registry Numbers

CAS Registry Number

  • 97259-96-6

System Generated Number

  • 0097259966

Structure Descriptors

InChI

1S/C26H40O6/c1-15(2)16-6-8-18-17(12-16)7-9-21-25(18,3)10-5-11-26(21,4)24(30)32-14-20(28)23-22(29)19(27)13-31-23/h7,12,15,18-23,27-29H,5-6,8-11,13-14H2,1-4H3/t18-,19-,20+,21+,22+,23+,25+,26+/m0/s1

InChIKey

BUPXEHBUWNOSOD-LZDABRNRSA-N

Smiles

CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)OC[C@H]([C@@H]4[C@@H]([C@H](CO4)O)O)O)C