ID: 98260
SMILES:c12c(c(O)cc(CCCCC)c1)-c1c(O)cc(-c3ccc(O)c(CC4CCC(C)(C)O4)c3O)c(O)c1CC2CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.704
CB1 binding score: -15.609
InChIKey:DCBLHCZCQHMINH-UHFFFAOYSA-N
ID: 98261
SMILES:O=CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.393
InChIKey:FRMGXHQCAWNSFJ-UHFFFAOYSA-N
ID: 98262
SMILES:O=c1cc2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(CO)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.356
InChIKey:CLDJSQJHEOEVJX-UHFFFAOYSA-N
ID: 98263
SMILES:COc1c2c(cc(CCCCC)c1O)OC(C)(C)C1Cc3c(ccc(C(=O)O)c-3)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -14.314
InChIKey:FGYJQQVMDDELQP-UHFFFAOYSA-N
ID: 98264
SMILES:C1(C)=CC(c2c(O)cc(CCCCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.188
InChIKey:GGHRHCGOMWNLCE-UHFFFAOYSA-N
ID: 98265
SMILES:C1(C)(c2c(OC(=O)C)cc(CCCCC)cc2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.078
InChIKey:GQJIFBMXXJPIIW-UHFFFAOYSA-N
ID: 98266
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=C3C(C)(C12)C(C(C)C=CC(OC)C(C)C)CCC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.347
InChIKey:VHEZCNDQRHQTPE-UHFFFAOYSA-N
ID: 98267
SMILES:C1C2c3c(cc(CCC)cc3O1)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -15.144
InChIKey:RPZKDOBSJRXKEH-UHFFFAOYSA-N
ID: 98268
SMILES:C(Cc1cc2c(c(O)c1)C1C(CC(O)C(C)(C)C1)C(C)(C)O2)(O)C(C)(O)CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.747
CB1 binding score: -14.014
InChIKey:LGAHDVSFKWGRGM-UHFFFAOYSA-N
ID: 98269
SMILES:CC1(C)C2(C)C3(C=CC2O3)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.263
InChIKey:XPXRCHPWNRAOLE-UHFFFAOYSA-N
ID: 98270
SMILES:C1(C)=CC2c3c(cc(CCCC(O)C)cc3OC1(C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.143
InChIKey:PMEQJDAJRDJKPV-UHFFFAOYSA-N
ID: 98271
SMILES:C1=C(C(=O)O)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 98272
SMILES:C1(C)C(C)(C)C2C(C)(Oc3c(c(O)cc(CCCCC)c3)C3OC(=O)C4(OO4)C3C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.468
InChIKey:QZMLDRVRAVPIPD-UHFFFAOYSA-N
ID: 98273
SMILES:C(C1CC2c3c(O)cc(CCCCC)cc3OC12CC(C)C)(O)=C1C(O)=C(C(=O)CC(C)C)C(=O)C(C)=C1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.708
CB1 binding score: -15.29
InChIKey:NWHXSRSKLBLYKA-UHFFFAOYSA-N
ID: 98274
SMILES:CC(C)CC(OC)c1c(O)c(C(OC)=O)c2c(c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.14
InChIKey:RSMLOEARBLQFEY-UHFFFAOYSA-N
ID: 98275
SMILES:c12cc(CCCCC)c(C(=O)O)c(O)c1C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.628
InChIKey:BQZDJENNXPKFQQ-UHFFFAOYSA-N
ID: 98276
SMILES:C1(c2c(O)cc(CC)cc2O)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 98277
SMILES:C1=C(C)CC2C(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: 98278
SMILES:CC(=CCc1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.913
InChIKey:SSXGVPSEIMSGLQ-UHFFFAOYSA-N
ID: 98279
SMILES:C12c3c(cc(CCCCC)cc3OC)C(C)(C(=O)CC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.628
InChIKey:VBEHQJCLQNUFQL-UHFFFAOYSA-N
ID: 98280
SMILES:Cc1ccc2c(c1C(OC)=O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.529
InChIKey:XHGUYVIAAUGRQT-UHFFFAOYSA-N