ID: 31081
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C3(O)C(C(=C)C(O2)O1)CCC(C)=C3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.956
InChIKey:FYQDBIPGEWSHMD-UHFFFAOYSA-N
ID: 31082
SMILES:Oc1c(C(CC(C)C)=O)c(O)c(C=O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 372.461
CB1 binding score: -17.581
InChIKey:JFADHCMLMYPJCV-UHFFFAOYSA-N
ID: 31083
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 31084
SMILES:c1(CCCCCC)cc(O)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.768
InChIKey:PPEWBSMCFPLYEB-UHFFFAOYSA-N
ID: 31085
SMILES:O(CC1CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1)C1OC(CO)C(O)C(O)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.625
CB1 binding score: -16.027
InChIKey:MLMHAQPORBAOPA-UHFFFAOYSA-N
ID: 31086
SMILES:CC1(O)CC2C(C(=O)C1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.062
InChIKey:AWSPPIVRPMPHFB-UHFFFAOYSA-N
ID: 31087
SMILES:O=C1C=CC(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1C=CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -16.279
InChIKey:SIJMXINDTIFQMK-UHFFFAOYSA-N
ID: 31088
SMILES:c1(CCCCC)cc2c(c(OC)c1)C1C=C(COC(=O)C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.577
InChIKey:AHQPABPKXKUGCW-UHFFFAOYSA-N
ID: 31089
SMILES:C1C23C(CCC1(C)OO2)C(C)(C)Oc1cc(CCCCC)cc(O)c13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.905
InChIKey:CQWTWIQSJDSRBM-UHFFFAOYSA-N
ID: 31090
SMILES:CC(=CCC(C(=C)C(CC=C(C)C)OC(=O)C)c1cc(O)c2c(c1C)OC(C)(C)C1C2C(O)C(C)=CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: -14.605
InChIKey:BIDVYTLOFLEYDE-UHFFFAOYSA-N
ID: 31091
SMILES:CC(C)=CCCC1(C)CCC(C)=CC(c2ccc(O)cc2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.655
InChIKey:AIBVOGUFFMZDSI-UHFFFAOYSA-N
ID: 31092
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(C=CC=CC)cc(O)c32)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -17.874
InChIKey:YGIFBXXJTRRDKS-UHFFFAOYSA-N
ID: 31093
SMILES:c1(CCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 31094
SMILES:CC(c1c(O)cc2c(c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.792
InChIKey:XJNQCCLSLVYFNV-UHFFFAOYSA-N
ID: 31095
SMILES:CC1(C)Oc2cc(O)c(C(CC(C)C)=O)c(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.439
InChIKey:MMBSMBBFKYDYEQ-UHFFFAOYSA-N
ID: 31096
SMILES:c1(C(O)=O)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -18.674
InChIKey:FPTJZRPHZMUVEY-UHFFFAOYSA-N
ID: 31097
SMILES:c1(-c2cc(O)c(O)c(O)c2CC=C(CCC=C(C)C)CO)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.666
CB1 binding score: -16.43
InChIKey:UVYZPXUUPDZLPD-UHFFFAOYSA-N
ID: 31098
SMILES:C1C2(C)c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.861
InChIKey:WTUFLVQDMFIMJQ-UHFFFAOYSA-N
ID: 31099
SMILES:C1(=C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C3C=C(C)CCC231
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -13.951
InChIKey:PLNVIWSFOKZMJZ-UHFFFAOYSA-N
ID: 31100
SMILES:CC1(C)C=CC(C2=CCC3C2(C)CCC(O)C3(C)C)Oc2cc(CCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: Not available
InChIKey:CLZBMUOIZYZTED-UHFFFAOYSA-N
ID: 31101
SMILES:CC1(C)OC2(CCC1C1(C)OC(C(C)=C)CC1)Oc1c(c(O)c(C(O)=O)c(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -13.281
InChIKey:NTFGGQWLOJXYTL-UHFFFAOYSA-N