Sanguiin H 10

CAS Registry Number®

98975-05-4

CAS Name

Sanguiin H 10

Molecular Formula

C68H48O44

Molecular Mass

1569.08

Cite this Page

Sanguiin H 10.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=98975-05-4 (retrieved 2024-11-22) (CAS RN: 98975-05-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C68H48O44/c69-19-1-12(2-20(70)37(19)77)59(94)112-68-58-57(109-64(99)17-8-25(75)41(81)46(86)32(17)33-18(65(100)110-58)9-26(76)42(82)47(33)87)55-29(106-68)11-103-62(97)15-6-23(73)43(83)48(88)34(15)35-36(66(101)108-55)56(51(91)50(90)49(35)89)104-27-4-13(3-21(71)38(27)78)60(95)111-67-53(93)52(92)54-28(105-67)10-102-61(96)14-5-22(72)39(79)44(84)30(14)31-16(63(98)107-54)7-24(74)40(80)45(31)85/h1-9,28-29,52-55,57-58,67-93H,10-11H2

InChIKey

InChIKey=GMFLQAPBSLUKQB-UHFFFAOYSA-N

SMILES

O(C1=C2C(C=3C(C(=O)OCC4C(OC2=O)C5C(C(OC(=O)C6=CC(O)=C(O)C(O)=C6)O4)OC(=O)C=7C(C=8C(C(=O)O5)=CC(O)=C(O)C8O)=C(O)C(O)=C(O)C7)=CC(O)=C(O)C3O)=C(O)C(O)=C1O)C9=CC(C(OC%10OC%11C(C(O)C%10O)OC(=O)C=%12C(C=%13C(C(=O)OC%11)=CC(O)=C(O)C%13O)=C(O)C(O)=C(O)C%12)=O)=CC(O)=C9O

Canonical SMILES

O=C1OCC2OC(OC(=O)C3=CC(O)=C(O)C(OC=4C(O)=C(O)C(O)=C5C4C(=O)OC6C(OC(OC(=O)C7=CC(O)=C(O)C(O)=C7)C8OC(=O)C9=CC(O)=C(O)C(O)=C9C%10=C(O)C(O)=C(O)C=C%10C(=O)OC86)COC(=O)C%11=CC(O)=C(O)C(O)=C%115)=C3)C(O)C(O)C2OC(=O)C%12=CC(O)=C(O)C(O)=C%12C%13=C(O)C(O)=C(O)C=C1%13

Other Names for this Substance

  • α-D-Glucopyranose, cyclic 2,3-[(1S)-4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] cyclic 4→2,6→2′-[(1S)-3-[5-[[[4,6-O-[[(1S)-4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-diyl]dicarbonyl]-β-D-glucopyranosyl]oxy]carbonyl]-2,3-dihydroxyphenoxy]-4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1-(3,4,5-trihydroxybenzoate)
  • α-D-Glucopyranose, cyclic 2,3-(4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate) cyclic 4,6-[3-[5-[[[4,6-O-[(4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-diyl)dicarbonyl]-β-D-glucopyranosyl]oxy]carbonyl]-2,3-dihydroxyphenoxy]-4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1-(3,4,5-trihydroxybenzoate), stereoisomer
  • 1H-Dibenzo[f,h]pyrano[3,4-b][1,4]dioxecin, α-D-glucopyranose deriv.
  • Dibenzo[g,i]pyrano[3,2-b][1,5]dioxacycloundecin, α-D-glucopyranose deriv.
  • Sanguiin H 10

CAS INSIGHTSTM
Targeted protein degrader structure, illustration