ID: 31228
SMILES:CCC=CCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.162
InChIKey:CMSIVDZJJHGODZ-UHFFFAOYSA-N
ID: 31229
SMILES:O(C(CCCCC)=O)C1C2C(c3c(cc(CCCCC)cc3O)O1)OC(C)(C)C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -15.981
InChIKey:NMDSAFFTTZSELE-UHFFFAOYSA-N
ID: 31230
SMILES:CC1(CC=C(C)CCCC(C)(O)C)C=Cc2c(c(C)cc(O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.87
InChIKey:SABWFAANQRKZHH-UHFFFAOYSA-N
ID: 31231
SMILES:c1(O)c(CCCCCC)cc(O)c2c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.855
InChIKey:YUBCAOZLMYWRFJ-UHFFFAOYSA-N
ID: 31232
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.39
InChIKey:LMFHZSDFXYYYTF-UHFFFAOYSA-N
ID: 31233
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 31234
SMILES:C(C)(C)=CCCC(=CCc1cc(O)c(C)cc1OC(=O)C(C)CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.078
InChIKey:CCXLFXNIUMWYKF-UHFFFAOYSA-N
ID: 31235
SMILES:OC(C(=C)C1Oc2cc(CCCCC)cc(O)c2C1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.132
InChIKey:PKNFHUVBRQJBDW-UHFFFAOYSA-N
ID: 31236
SMILES:C1C(C(C)C)C(c2c(O)c(C(O)=O)cc(CCCCC)c2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 344.495
CB1 binding score: -15.87
InChIKey:JZZJCCTUJKXMGD-UHFFFAOYSA-N
ID: 31237
SMILES:c1(CC=C)c(O)c(C2C(C(C)=C)CC(CC=C(C)C)C2=C)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: Not available
InChIKey:TZLWVNNOHSJMIC-UHFFFAOYSA-N
ID: 31238
SMILES:C1(C)(C)C2C(C3(C)Oc4c(c(O)cc(CCCCC)c4)C4C3C(CCC4C)C2)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -14.612
InChIKey:RQEKLFFFHDYLKB-UHFFFAOYSA-N
ID: 31239
SMILES:C(=CC=C(CCC1OC1(C)C)C)C(C)=CCc1c(O)c(C)cc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.538
InChIKey:GRTRKSHKNNIASQ-UHFFFAOYSA-N
ID: 31240
SMILES:Oc1c(O)c2c(cc1CC1C(C)(C)CCCC1C)OC(C)(C)C1CCC(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.566
InChIKey:WKJQRNYHAWPDOR-UHFFFAOYSA-N
ID: 31241
SMILES:c12c(c(O)cc(CCCCC)c1)C1CC(C)(C2)CCC1C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.545
InChIKey:LRYSPWXTCHNYMD-UHFFFAOYSA-N
ID: 31242
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 31243
SMILES:C(Cc1c(C(=O)O)c(O)cc2c1OC(C)(C)C1C2CC(CO)=CC1)(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.405
CB1 binding score: -15.658
InChIKey:UAPPTFGMBOQCKJ-UHFFFAOYSA-N
ID: 31244
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)-c2c1c(C(=O)CCC)cc(CC=C(C)CCC=C(C)C)c2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.684
CB1 binding score: -9.514
InChIKey:GIRKKNQVLFIXHC-UHFFFAOYSA-N
ID: 31245
SMILES:c1(CC=C)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.957
InChIKey:MTBKFELEBUQONK-UHFFFAOYSA-N
ID: 31246
SMILES:C1C(C)C2C(O)C(O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.55
InChIKey:NCVSTOJXSBXGNY-UHFFFAOYSA-N
ID: 31247
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCC)c2)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.295
CB1 binding score: -16.922
InChIKey:GFPILZJSNHMEGH-UHFFFAOYSA-N
ID: 31248
SMILES:c1cc(C(=O)O)c2c(c1CCCCC)OC(C)(C)c1c-2cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -15.422
InChIKey:AEHHMAABVIYLCG-UHFFFAOYSA-N