ID: 61258
SMILES:CC(O)(C1CCC(O)(C)C(O)CCC2(C)Oc3c(c(O)cc(CCCC)c3)C12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.563
CB1 binding score: -15.12
InChIKey:IKOMEKUBJYNKON-UHFFFAOYSA-N
ID: 61259
SMILES:CC12C(=O)C=C(C)C(C)C1Cc1c(O)c(C(C(CCC)=O)C)c(O)c(C(=O)CCCCC)c1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -15.279
InChIKey:FOZSZFFBDUKRKL-UHFFFAOYSA-N
ID: 61260
SMILES:ClC12c3c(O)c(C(=O)O)c(CCCCC)cc3OC(C)(C)C1CC(C(=C)C)C2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 475.069
CB1 binding score: -16.668
InChIKey:AISRSOZDGSZRBF-UHFFFAOYSA-N
ID: 61261
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(OC)cc(OC)c3C(OC)=O)CCC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -17.285
InChIKey:AWMZEJMRFWQHJM-UHFFFAOYSA-N
ID: 61262
SMILES:C12C(C)(CC(O)CC1(C)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.906
InChIKey:DLZOIILMDQLHIN-UHFFFAOYSA-N
ID: 61263
SMILES:C12C(C)(CCCC1(C)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 61264
SMILES:O(c1c(O)c(C)cc2c1C1C(C(C)(C)O2)CCC1(C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -17.204
InChIKey:ANCYQXOVGCEUMT-UHFFFAOYSA-N
ID: 61265
SMILES:C1(C)=CC(=O)C2C3C1C(C)(C)Oc1cc(CCCCC)cc(c13)OC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -11.545
InChIKey:RLJRIHMRZBWPDA-UHFFFAOYSA-N
ID: 61266
SMILES:C1(=O)c2c(c(C(=O)O)c(CCCCC)cc2O)OC1(CCC=C(CCC=C(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.214
InChIKey:PIOGCAHXCBKDRE-UHFFFAOYSA-N
ID: 61267
SMILES:O1c2c(ccc(CCCCC)c2O)C2C(C1(C)C)C=C(C)CCC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.603
InChIKey:OXATVSLKRBGUDQ-UHFFFAOYSA-N
ID: 61268
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 61269
SMILES:C1(=O)C(C)CCCC(C)=CCC2C(C)(C)Oc3cc(C)cc(O)c3C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.171
InChIKey:VBUOLKKKVXGXGX-UHFFFAOYSA-N
ID: 61270
SMILES:C1C(C)(O)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 61271
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(CO)CCC1C2(CCC=C(C)C)C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: Not available
InChIKey:YLEACOXHFAXGSU-UHFFFAOYSA-N
ID: 61272
SMILES:CCCCCc1cc2c(c(O)c1)C1=C(C(=O)C(CC)C)C(=O)C(C)(C)OC1(O)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -13.224
InChIKey:ROVGINQNCHRPAE-UHFFFAOYSA-N
ID: 61273
SMILES:O(C)c1cc(CCCC)cc2c1OC(C)(C)C1C2C=C(C)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.806
InChIKey:JEIHZBRFSGUSJY-UHFFFAOYSA-N
ID: 61274
SMILES:c1c(CCCCCC)cc(O)c2c1OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.585
InChIKey:NZUUGMLOXJAJLR-UHFFFAOYSA-N
ID: 61275
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 61276
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 61277
SMILES:Oc1c2c(c3c(c1)C1C(O)C(C)=CCC1C(C)(C)O3)CCCC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.548
InChIKey:XLOZPOHNGKPIHM-UHFFFAOYSA-N
ID: 61278
SMILES:CC1(CC(=O)C=C(C)C)Oc2c(c(O)cc(CCCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.351
InChIKey:VGZYHEBZMRCAFG-UHFFFAOYSA-N