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Substance Name: Mollicellin D
RN: 68455-11-8
UNII: AB983U35T0
InChIKey: AINFZKIGIQBKDM-UHFFFAOYSA-N

Molecular Weight

  • 404.844
 
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Names and Synonyms

Name of Substance

  • Mollicellin D

Synonyms

  • 2-Chloro-3,7-dihydroxy-4-(hydroxymethyl)-1,9-dimethyl-8-(3-methyl-2-butenyl)-11H-dibenzo(b,e)(1,4)dioxepin-11-one
  • UNII-AB983U35T0

Systematic Name

  • 11H-Dibenzo(b,e)(1,4)dioxepin-11-one, 2-chloro-3,7-dihydroxy-4-(hydroxymethyl)-1,9-dimethyl-8-(3-methyl-2-butenyl)-

Registry Numbers

CAS Registry Number

  • 68455-11-8

FDA UNII

  • AB983U35T0

System Generated Number

  • 0068455118

Structure Descriptors

InChI

1S/C21H21ClO6/c1-9(2)5-6-12-10(3)19-15(7-14(12)24)27-20-13(8-23)18(25)17(22)11(4)16(20)21(26)28-19/h5,7,23-25H,6,8H2,1-4H3

InChIKey

AINFZKIGIQBKDM-UHFFFAOYSA-N

Smiles

O1c2c(Oc3c(C1=O)c(c(c(c3CO)O)Cl)C)cc(c(c2C)C\C=C(\C)C)O