ID: 117349
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 117350
SMILES:CC(C)=CCCC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 117351
SMILES:C(=C)C1(CC)CCc2c(c(O)cc(CCCCC)c2)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.436
InChIKey:OUEGTTBDRYPGRS-UHFFFAOYSA-N
ID: 117352
SMILES:c1(C2C(C(C)(O)C)CCC(C)=C2)c(O)c(O)c(C(=O)O)c2c1OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.222
InChIKey:ZUXYZPOHSYGCSU-UHFFFAOYSA-N
ID: 117353
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.767
InChIKey:OGCCABVUOZBTQV-UHFFFAOYSA-N
ID: 117354
SMILES:C(C1c2cc(O)c(C)cc2OC1(C)C)C1(C)CC=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 300.442
CB1 binding score: -16.207
InChIKey:VFHDSUYGEPIRFC-UHFFFAOYSA-N
ID: 117355
SMILES:C1(CC2c3c(O)cc(CCCCC)cc3OC2(C)C)C(C)CCC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.078
InChIKey:ATNIHYZUJVBHDV-UHFFFAOYSA-N
ID: 117356
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.945
InChIKey:BMHWBDFIQAZUEO-UHFFFAOYSA-N
ID: 117357
SMILES:NCCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -15.929
InChIKey:HPLUXHSQBKSZML-UHFFFAOYSA-N
ID: 117358
SMILES:c1(C(C)CCCCCCCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -14.603
InChIKey:UJUOZRLUDHUUOM-UHFFFAOYSA-N
ID: 117359
SMILES:c1(COC(=O)C=C(C)COC(=O)CC(C)C)cc(OC)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -16.078
InChIKey:HXJCAIHRDITXDI-UHFFFAOYSA-N
ID: 117360
SMILES:C(C=C(C)CCCC(C(=O)C=CC(C)(C)O)C)(=O)c1c(O)cc(OC)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: -16.173
InChIKey:SZAMDQKVPYBLCK-UHFFFAOYSA-N
ID: 117361
SMILES:c1c(CCCCC)cc2c(c1O)C1CC(C(C)(O)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.428
InChIKey:RMGLMIJXAXQQNY-UHFFFAOYSA-N
ID: 117362
SMILES:C1(C)(C)C2(CCC(CO)=CC2)c2c(cc(C)c3c2OC3C(O)C(C)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.731
InChIKey:LPYSEDVACUGHJD-UHFFFAOYSA-N
ID: 117363
SMILES:C(c1cc(OC)c(OC2C(C(C)=C)CCC(C)=C2)cc1)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.126
InChIKey:PYIVZQDIOKVWEQ-UHFFFAOYSA-N
ID: 117364
SMILES:O(C1OC(CO)C(O)C(O)C1O)C1C(CCCC(C)(O)C)(C)Oc2cc(C)cc(O)c2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.532
CB1 binding score: -15.527
InChIKey:QQFFYZLFPTVZKG-UHFFFAOYSA-N
ID: 117365
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)C)CCC(C)(C1)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.393
InChIKey:NGTPJAMOWNUXOS-UHFFFAOYSA-N
ID: 117366
SMILES:c1(OC(=O)C)cc2c(cc1CCC)OC(CCC(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.074
InChIKey:HJPFMQQRQKEZSS-UHFFFAOYSA-N
ID: 117367
SMILES:c1(O)c2c(cc(C)c1)OC(C)(C)C1CC2C(CCCC(CO)=C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.374
InChIKey:IKVOFQXMHBLHLT-UHFFFAOYSA-N
ID: 117368
SMILES:C(=O)(c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -18.079
InChIKey:AYVVBMDDEODWMD-UHFFFAOYSA-N
ID: 117369
SMILES:O1c2c(c(O)cc(CCCCC)c2)C=CC1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N