ID: 3403
SMILES:c1(O)c(C(O)=O)c(CCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.285
InChIKey:NIVFVXYHFPSETN-UHFFFAOYSA-N
ID: 3404
SMILES:C1=C(CO)CCC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.328
InChIKey:IWHYDYORMMBLMI-UHFFFAOYSA-N
ID: 3405
SMILES:C(CCc1cc2c(cc1O)C(O)C1C3(C)C(C(O)CC1(C)CCCO3)O2)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -14.115
InChIKey:TYJUIFGJOAIYHE-UHFFFAOYSA-N
ID: 3406
SMILES:C(C)(C1CC2c3c(cc(CCCCC)cc3O)OC2(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.855
InChIKey:VBMSTUJNROPVAW-UHFFFAOYSA-N
ID: 3407
SMILES:CC12C3(C)CC(=O)CC(C(O)=O)(C)C3CCC1(C)Oc1cc(CCCCC)ccc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.6
InChIKey:OLUSNVWYBICTQF-UHFFFAOYSA-N
ID: 3408
SMILES:O1c2cc(CCCCC)c(C(=O)O)c(O)c2C(C)CC1CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -11.603
InChIKey:KSYHSCSBQZYDCN-UHFFFAOYSA-N
ID: 3409
SMILES:C1c2c(cc(CCCCC)cc2O)OC(C)(C)C1CCC(O)(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.098
InChIKey:KLEYGMLWPGXILB-UHFFFAOYSA-N
ID: 3410
SMILES:C1(O)CCC(C)=CC2C1C(C)(C)Oc1c2c(O)c(CC=C(C)CCCC(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.732
CB1 binding score: -12.673
InChIKey:HGWDSZSCKJCUCR-UHFFFAOYSA-N
ID: 3411
SMILES:C12OC(OC)CC(C)C1(CC)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.692
InChIKey:QWHWZIXMTPUWEJ-UHFFFAOYSA-N
ID: 3412
SMILES:O(C(=NOC(C(C)Cl)=O)COc1c(CC=C(C)C)c(O)cc(CCCCC)c1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.953
CB1 binding score: -12.872
InChIKey:MDBCTTMINQFWHB-UHFFFAOYSA-N
ID: 3413
SMILES:C12C3(CO)C(CCC1(C)Oc1cc(CCCCCC)cc(O)c1O2)C(C)(C)CCC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -12.62
InChIKey:UYLPGYNWDRDQKE-UHFFFAOYSA-N
ID: 3414
SMILES:C(c1c(C)c2c(c(OC)c1)C=CC(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -15.507
InChIKey:RFGCTWWKQAHTBV-UHFFFAOYSA-N
ID: 3415
SMILES:c1(=O)c(C)c(C)c(O)c(C(C)=CC(CC)C)c2c1C1C(CCC1C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -13.978
InChIKey:HXIXCPGZUIUNCE-UHFFFAOYSA-N
ID: 3416
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC(O)O2)C2(C)CCCC(C)(C)C2C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -17.698
InChIKey:JOSUPFXPILTQKU-UHFFFAOYSA-N
ID: 3417
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C(O)C1C(=C)C(O)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.205
InChIKey:BRZCHXCFSVVLSB-UHFFFAOYSA-N
ID: 3418
SMILES:C(=CCC(C(=C)C)CC=C(COC(=O)C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: Not available
InChIKey:VBSDMGPFGNVURP-UHFFFAOYSA-N
ID: 3419
SMILES:C12c3c(O)cc(CC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 3420
SMILES:C12c3c(O)c(C(=O)O)c(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 3421
SMILES:CC1CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -16.124
InChIKey:LRIDODXBBYTTIP-UHFFFAOYSA-N
ID: 3422
SMILES:C(CCC1(C)C=Cc2c(O)cc(CCCCC)cc2O1)(C)CCCC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.813
InChIKey:PXPUYKFHLIUYLH-UHFFFAOYSA-N
ID: 3423
SMILES:c12cc(CCCCC)cc(O)c1CC(CC=C(C)C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.824
InChIKey:INTNPSTYODPHGD-UHFFFAOYSA-N