ID: 33307
SMILES:C(C1=CCCC2C(C)(C)Oc3c(c(O)c(C(O)=O)c(CCCC)c3O)C12)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -17.337
InChIKey:XXGYKDCKMBZFCE-UHFFFAOYSA-N
ID: 33308
SMILES:Cc1c2c(cc(CCCCC)c1)C(=O)C1(O2)CC(C)(C)OC2(C)CCCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.285
InChIKey:CGJBYNCBFAABNS-UHFFFAOYSA-N
ID: 33309
SMILES:C(C(CC)C)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.293
InChIKey:BOZCGTBFBPFIQB-UHFFFAOYSA-N
ID: 33310
SMILES:C1C(c2c(O)cc(CCCCC)cc2)C2C(C(C)(C)Oc3c2c(O)c(C(CCc2ccccc2)=O)c(O)c3C=O)CC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 610.791
CB1 binding score: -10.229
InChIKey:ZAQYWFBOPJAQBR-UHFFFAOYSA-N
ID: 33311
SMILES:C1CC(C(=O)O)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 33312
SMILES:O1c2c(c(O)cc(C)c2)C2C=C(C)CCC2C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.209
InChIKey:NCTXDMHDVYEHIX-UHFFFAOYSA-N
ID: 33313
SMILES:C1(CO)C(C)(C)Oc2cc(CCC)c(O)c(C(C(=C)C)=O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.627
InChIKey:MPAYGWPEMJLVPF-UHFFFAOYSA-N
ID: 33314
SMILES:O=C(OCCCCCc1ccc(OC)c(C2C(C(C)=C)CCC(C)=C2)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: Not available
InChIKey:GDNNMYAKIVPQEW-UHFFFAOYSA-N
ID: 33315
SMILES:c1c(CCCCCC)cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.249
InChIKey:DIUDOWCLBJLSES-UHFFFAOYSA-N
ID: 33316
SMILES:C1(O)CCC(C)(C)C(O)(C(OC)=O)C12CC1c3c(cc(CCCCC)cc3O1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -11.735
InChIKey:FHXQYDKCQGMFLL-UHFFFAOYSA-N
ID: 33317
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C2)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.79
InChIKey:XQKKQKVZTUMWGM-UHFFFAOYSA-N
ID: 33318
SMILES:O1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -18.485
InChIKey:VHXCSYJPEQEEFQ-UHFFFAOYSA-N
ID: 33319
SMILES:C1(CCCC(C)=CC)(C)Oc2c(C)cc(O)cc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.604
InChIKey:ULIANYNWDFPWAN-UHFFFAOYSA-N
ID: 33320
SMILES:C(OCC1=CC2C(C(C)(C)Oc3cc(C)ccc32)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -12.688
InChIKey:JJYHGQCIEDIAMA-UHFFFAOYSA-N
ID: 33321
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 33322
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1(C(O)=C(C(c3cc(O)c(O)cc3)=O)C(=O)C(CCCCC)=C1O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.675
CB1 binding score: -15.746
InChIKey:ZMCVPWCGAKEJQD-UHFFFAOYSA-N
ID: 33323
SMILES:C(C=C(C)CCC=C(C)CCC=C(C)C)c1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 33324
SMILES:C=C(C)C1CCC(C)=CC1c1cc(CCNC)ccc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 299.458
CB1 binding score: -18.57
InChIKey:ZKBBKDQCHSPYPC-UHFFFAOYSA-N
ID: 33325
SMILES:Oc1c2c(c(Cl)c(C(CCCCC)=O)c1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.923
CB1 binding score: -15.12
InChIKey:NFYZHCTTZFKOPN-UHFFFAOYSA-N
ID: 33326
SMILES:C1CC(C2CCC(C)=CC2)(C)Oc2c(Cc3c(CCCCC)cc4c(c3O)C=CC(CCC=C(C)C)(C)O4)cc(O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 600.84
CB1 binding score: -15.188
InChIKey:RXBBRDUPAQOWNA-UHFFFAOYSA-N
ID: 33327
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N