ID: 80221
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(C=O)c3O)OC(CC2)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.218
InChIKey:SKFLEHYZAWPSPS-UHFFFAOYSA-N
ID: 80222
SMILES:C=C(Cc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -16.876
InChIKey:TYAVYZJKUIDJHY-UHFFFAOYSA-N
ID: 80223
SMILES:c1(O)cc(OC)c(C2C(C(C)=C)CC(Cl)C(C)=C2)c(OC(=O)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.842
CB1 binding score: -14.254
InChIKey:MIBROHCWVMFWME-UHFFFAOYSA-N
ID: 80224
SMILES:C(Cc1c(C)c2c(c(OC)c1)CC1C3(C2)C(=O)OC(C)(C)C3CC1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.616
InChIKey:VVBUVDPWJIIYDP-UHFFFAOYSA-N
ID: 80225
SMILES:OC1C(O)(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.774
InChIKey:GKYGKYSJIDSYCQ-UHFFFAOYSA-N
ID: 80226
SMILES:C(C)(C1CCC2(C)C1C1C(C)(Oc3cc(CCC)cc(O)c31)CC2)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.364
InChIKey:FQJBTLXUWHJILT-UHFFFAOYSA-N
ID: 80227
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)-c2cc(O)c(CC=C(C)C)c(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -13.281
InChIKey:AWLYYZYZTDUFMM-UHFFFAOYSA-N
ID: 80228
SMILES:C(CCCc1cc(O)c2c(c1O)CC1C(C)(O2)CCC(=C(C)C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.882
InChIKey:UURVPXXYKIFUOI-UHFFFAOYSA-N
ID: 80229
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.265
InChIKey:KTPDAZGMXXWSMU-UHFFFAOYSA-N
ID: 80230
SMILES:C(C)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 80231
SMILES:C(CC)Cc1cc(OC)c2c(c1)OC(C)(C)C1CCC(COC(CC(CC)C)=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: Not available
InChIKey:WSGZULSSTLZBOL-UHFFFAOYSA-N
ID: 80232
SMILES:CC(C)CCCC(Oc1c(OC)cc2c(c1)OC(C)(C)C1CCC(C)=CC21)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.303
InChIKey:DFBZIBFTMUZYBI-UHFFFAOYSA-N
ID: 80233
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(CC=C(C)C)c(O)c(C(=O)C(CC)C)c3O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.583
InChIKey:RVZIJARJLMNHHY-UHFFFAOYSA-N
ID: 80234
SMILES:Oc1c2c(c3c(c1)-c1c(c(O)cc(C)c1O)C(C)C3)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -14.041
InChIKey:INYFVOGSUYHDMR-UHFFFAOYSA-N
ID: 80235
SMILES:CCCCCc1c(O)c2c(c(C(C(C)C)=O)c1O)OC(C)(C)C1CCC(C)(O)C(O)C12O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.572
CB1 binding score: -12.721
InChIKey:SDGDEMCBAZHPQJ-UHFFFAOYSA-N
ID: 80236
SMILES:Oc1c2cc(cc1)OC(CCC=C(C)C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -11.576
InChIKey:XAPZLPXSPKUPKL-UHFFFAOYSA-N
ID: 80237
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)-c2ccccc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.356
CB1 binding score: -17.834
InChIKey:ZLHQMHUXJUPEHK-UHFFFAOYSA-N
ID: 80238
SMILES:Cc1cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1CC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.6
CB1 binding score: -15.369
InChIKey:FDGRBPZSPUWJER-UHFFFAOYSA-N
ID: 80239
SMILES:CC1(C)C2CC(C(C)=O)C3C(C)=CC1c1c(cc(CCCCC)cc1O)OC23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.761
InChIKey:QMEGASCOAJBTGC-UHFFFAOYSA-N
ID: 80240
SMILES:C12C(CC=C(C)C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 80241
SMILES:CC(=C)C1C(c2c(O)cc(CCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N