ID: 55336
SMILES:C1=CC(C)(C)C2C(C)(C1O)Oc1c(c(O)cc(CCCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.265
InChIKey:NEKYILMAKMZHGJ-UHFFFAOYSA-N
ID: 55337
SMILES:OC(C(c1c(OCCN(C)C)cc(C)c(OC)c1)=O)c1cc2c(cc1C)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 575.79
CB1 binding score: -15.937
InChIKey:QVRFTIIBXZLIEZ-UHFFFAOYSA-N
ID: 55338
SMILES:C1(CCC=C(C)C)(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 55339
SMILES:c1(CCCCC)c(O)c2c(o1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.648
InChIKey:CISIXFLDVBNEFH-UHFFFAOYSA-N
ID: 55340
SMILES:C(=CCCC(C)=CCCC(C1Cc2c(cc(O)cc2C)O1)(O)C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.705
InChIKey:RUPWNCNTPLCLOH-UHFFFAOYSA-N
ID: 55341
SMILES:CC12C(C(C)(OC(=O)CCC)C)CCC(O)(C)C(O)C1c1c(cc(CCCCC)o1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.589
CB1 binding score: -18.72
InChIKey:XOBRZCGIWNBQKG-UHFFFAOYSA-N
ID: 55342
SMILES:CC(O)(C1Oc2cc(CCCCC)c(O)cc2C2CC(C)=CCC12O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.745
InChIKey:HUVMSRVRHOXEQX-UHFFFAOYSA-N
ID: 55343
SMILES:C1=CC(CCC=C(C)C)(C)Oc2c1c(O)cc(CCC)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 55344
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(=O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -18.334
InChIKey:HJLDQSFDBVFHQA-UHFFFAOYSA-N
ID: 55345
SMILES:c1(C(=O)O)c2c(ccc1O)C(C)(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -16.341
InChIKey:FPMFCSSYSPDXOS-UHFFFAOYSA-N
ID: 55346
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 55347
SMILES:C(CC(CCCC(C)=CCCC(C)=CCc1cc(O)c(O)c(OC(C)=O)c1)O)C=C1COC(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -14.732
InChIKey:AGFLRSOHYRSTLD-UHFFFAOYSA-N
ID: 55348
SMILES:C=C(C1CC2c3c(cc(CCCCC)cc3O)OC(C)(C1)C(O)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.91
InChIKey:UPAJDCDROCBEBA-UHFFFAOYSA-N
ID: 55349
SMILES:c1(O)cc(CCCCC)c(O)c2c1C1(O)CC(=O)C(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.154
InChIKey:SCZLHTTZKLBPRZ-UHFFFAOYSA-N
ID: 55350
SMILES:C(=O)(Oc1cc2c(cc1C)OC(CCC=C(C)C)(C)C=C2)CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.399
InChIKey:ORIFDKMFMWXLIX-UHFFFAOYSA-N
ID: 55351
SMILES:C(CC=C(C)C)C(=CCc1c(O)c2c(c(C(=O)CCC)c1O)OC(C)(C)C1C2C=C(CO)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 482.661
CB1 binding score: -13.797
InChIKey:HYJDIBSNWYINDZ-UHFFFAOYSA-N
ID: 55352
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)C(OC)C=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.897
InChIKey:JSPQZVRZWDTZBZ-UHFFFAOYSA-N
ID: 55353
SMILES:O(c1c2c(c(C(=O)O)c(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.29
InChIKey:QWFZRIOXBUJJJA-UHFFFAOYSA-N
ID: 55354
SMILES:C(Cc1c(CO)c2c(cc1)-c1c(ccc(C)c1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -14.909
InChIKey:QVFCZMXIPOFSIO-UHFFFAOYSA-N
ID: 55355
SMILES:c1(OC)c(C2C=C(C)CCC2C(C)=C)c(O)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.218
InChIKey:UZWBOVFGUISXLX-UHFFFAOYSA-N
ID: 55356
SMILES:C(C)(=CCCC(=CCCC(C)=CCc1cc(O)c(CC(=O)O)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids;Tetraketide meroterpenoids
MW: 372.505
CB1 binding score: -18.306
InChIKey:BDRGSNYWOXCBFU-UHFFFAOYSA-N