ID: 112078
SMILES:C1(C)=C2C(OC1=O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.214
InChIKey:UOUKUSYUWMHURH-UHFFFAOYSA-N
ID: 112079
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 112080
SMILES:Oc1c(C2CC(C)=CCC2C(C)(O)C)cc(CCCCC)c(C(OC(C)(C)C)=O)c1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: Not available
InChIKey:YSQPONOOCHFCTK-UHFFFAOYSA-N
ID: 112081
SMILES:C=C(C)C1C(c2c(O)cc(O)c(CCCCC)c2)C=C(CO)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.934
InChIKey:NONNCSFVHFLJEO-UHFFFAOYSA-N
ID: 112082
SMILES:C1=CC(C(C)(C)C)C(c2cc(CCCCC)cc(O)c2O)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -13.401
InChIKey:RELVZUNOVULZIE-UHFFFAOYSA-N
ID: 112083
SMILES:CCOC(=O)c1cc2c(c(C(=O)CCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -19.027
InChIKey:JENSGSZTXVIGON-UHFFFAOYSA-N
ID: 112084
SMILES:CC(C)(O)C=CCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.639
InChIKey:YPQWGXMNDAZBBL-UHFFFAOYSA-N
ID: 112085
SMILES:Oc1c(CC=C(CC=CC(C)(C)O)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.579
InChIKey:CJLAIIYOHPCHDP-UHFFFAOYSA-N
ID: 112086
SMILES:C1CC2(C)CCC(O)(C(CO)=C)C2C1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.211
InChIKey:NBJWHEJSJVOIPM-UHFFFAOYSA-N
ID: 112087
SMILES:CC(C#Cc1c(O)cc(CCCCC)cc1O)C=CC(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.466
InChIKey:DBYLTPFQLSQATM-UHFFFAOYSA-N
ID: 112088
SMILES:c1cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 112089
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 112090
SMILES:C(C(CCC(=CCCC1(C)CCc2c(O)ccc(O)c2C1)O)C)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -15.624
InChIKey:YLKKLRDXNKOVKN-UHFFFAOYSA-N
ID: 112091
SMILES:C(C)(C1CCC(C)CC1c1c(O)cc(C2C=C(C)CCC2C(C)=C)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -12.561
InChIKey:PVJMNLWOQZJJOG-UHFFFAOYSA-N
ID: 112092
SMILES:OC1(C)CCC(C(O)(C)C)Oc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -15.75
InChIKey:JXJNCGKCYOEHKA-UHFFFAOYSA-N
ID: 112093
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.855
InChIKey:KBTNQOVTNZTJGJ-UHFFFAOYSA-N
ID: 112094
SMILES:CC1=CC2C(C(C)(C)Oc3c2cc(C)c(Br)c3)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.257
CB1 binding score: -12.892
InChIKey:CVZMTHCFDMKXBS-UHFFFAOYSA-N
ID: 112095
SMILES:C1(O)(C)CCC(C(C)(O)C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -17.275
InChIKey:RXTYYNMNCZQPLI-UHFFFAOYSA-N
ID: 112096
SMILES:c1(CC(=O)O)cc(O)c(O)c(C2C(C(=C)C)CCC(C)=C2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.239
InChIKey:UJGQLXCJIBBPDA-UHFFFAOYSA-N
ID: 112097
SMILES:OC1C(O)(C(C)(O)C)Oc2cc(C)cc(O)c2C1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.857
InChIKey:AJXTWXZWOWLCFS-UHFFFAOYSA-N
ID: 112098
SMILES:C1(O)C(C)=CC(c2c(O)cc(CCCCC)cc2OCC=C(CCC=C(C)C)C)C1C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -14.464
InChIKey:QZAFGMQMXJMHCL-UHFFFAOYSA-N