ID: 103090
SMILES:C1CC(C(C)=C)C(c2c(C)c(=O)c(Br)c(C)c(O)c2CC=C(CCC=C(C)C)C)C(O)=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 515.532
CB1 binding score: -15.587
InChIKey:YWUPXLNGJISGHL-UHFFFAOYSA-N
ID: 103091
SMILES:OC(=O)C1(C)CCCC2(C)C3c4c(cc(CCCCC)cc4O)OC(C)(C)C3CCC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -16.961
InChIKey:YPFNWWCBXQTJNB-UHFFFAOYSA-N
ID: 103092
SMILES:c12c(O)cc(CCC)cc1C1CC(C)(C(O)CCC(C)=C1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.813
InChIKey:PXMKETIVBBPLDQ-UHFFFAOYSA-N
ID: 103093
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)NC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -17.538
InChIKey:OOXPUPGAYGGCGA-UHFFFAOYSA-N
ID: 103094
SMILES:c1c(CCN)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -14.801
InChIKey:QGCPMRISDDXIHG-UHFFFAOYSA-N
ID: 103095
SMILES:c1(CC2C(=O)OC(C)(C)C3C(C2CO)C(C)C2C3CC(=O)C2)c(C)cc(OC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -12.231
InChIKey:NPTFVHKSRZCNOX-UHFFFAOYSA-N
ID: 103096
SMILES:c1(C)cc(C=O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -16.48
InChIKey:DJQHTVUAMNRHAB-UHFFFAOYSA-N
ID: 103097
SMILES:c1(C2C=C(C)CCC2C(C)=C)cc(CO)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.895
InChIKey:JCJCYXYHJVNYGW-UHFFFAOYSA-N
ID: 103098
SMILES:C1(OC)C(CC(=O)C=C(C)C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.195
InChIKey:ZXLGBSGGJCHBAI-UHFFFAOYSA-N
ID: 103099
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 103100
SMILES:CC1(C)Oc2c(cc(O)cc2C)C2CC(C)=CC(=O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -15.924
InChIKey:VRJWAPVQLCZZJI-UHFFFAOYSA-N
ID: 103101
SMILES:C(C)C(C(=O)CC(=CCCC1=CC(c2c(O)cccc2O)CC1)C)C(C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.64
InChIKey:JVGCINLCRXXMKH-UHFFFAOYSA-N
ID: 103102
SMILES:C1c2c(ccc(CCCC)c2)OC(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -15.909
InChIKey:YDPMHOQAXZWISL-UHFFFAOYSA-N
ID: 103103
SMILES:CC1(C)C2=C(c3c(O)cc(CCCCC)cc3OC2(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.931
InChIKey:ACIYIPIYUKZQNF-UHFFFAOYSA-N
ID: 103104
SMILES:c1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 103105
SMILES:C1C=C(c2ccc(C)c(CCC(C)(O)C=CC3(C)C(=O)CC(C(C)=C)CC3)c2O)OC(C)(C)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -16.642
InChIKey:GMKGNLNNNMSCLE-UHFFFAOYSA-N
ID: 103106
SMILES:Clc1cc(O)c(C2C34C(CCC(C)(CC3)OC4OC)C(C)(C)O2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.885
CB1 binding score: -15.46
InChIKey:GRXFRWLVLRBYQF-UHFFFAOYSA-N
ID: 103107
SMILES:C(CCC)Cc1cc(O)c(C2C(C(C)(O)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 103108
SMILES:C1(Oc2cc(CCCCC)cc(O)c2CC=C(C)C)C2C(=C)C(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: Not available
InChIKey:NHONXEFLMNCSIH-UHFFFAOYSA-N
ID: 103109
SMILES:Oc1cc(CCC)cc2c1C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 103110
SMILES:C(CCCc1cc2c(c(OC)c1)C1CC(C3(C)CCC(C(N=C)(C)C)OO3)OC1(CC(C)=C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 499.692
CB1 binding score: -13.81
InChIKey:UCJTWYHQGWFKHT-UHFFFAOYSA-N