ID: 109579
SMILES:C1C2C(C)(C)Oc3cc(C)cc(O)c3C2C(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.606
InChIKey:GOMHNRLYZFVMMN-UHFFFAOYSA-N
ID: 109580
SMILES:CC(C1C(=O)c2c(O)cc(CCCCC)cc2OC1(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.041
InChIKey:RGDJSZNLEPPXQV-UHFFFAOYSA-N
ID: 109581
SMILES:O1c2cc(CCCCC)cc(O)c2CC1C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -17.853
InChIKey:JQQLBXJIVIPHIW-UHFFFAOYSA-N
ID: 109582
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 109583
SMILES:C1C2c3c(O)cc(CCCCC)cc3OC(O)(CC1C(=O)OC)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -11.159
InChIKey:BOIRLAYZVQJYDS-UHFFFAOYSA-N
ID: 109584
SMILES:CC(C)C=CCC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.7
InChIKey:UHOHHFKVULSFEH-UHFFFAOYSA-N
ID: 109585
SMILES:C1C2C(CC(C)=C1)c1ccc(O)cc1OC2(CO)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -14.707
InChIKey:YLYLXSBUEUWFEC-UHFFFAOYSA-N
ID: 109586
SMILES:CC1C2Cc3c(cc(CCCCC)c(C)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.174
InChIKey:CGCGAZZXQIBIGY-UHFFFAOYSA-N
ID: 109587
SMILES:c1c(C)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 109588
SMILES:Oc1cc(C)c2c(c1CCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.334
InChIKey:SPUFMKPZACPKRE-UHFFFAOYSA-N
ID: 109589
SMILES:C1CC(O)C2(O)C(C1(C)C)Oc1c(c(OC)cc(CCCCC)c1)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.721
InChIKey:VIPFUUIFEBSLKE-UHFFFAOYSA-N
ID: 109590
SMILES:C1(C)(C)C(O)CCC(C)=C1CCC1(C)C=Cc2c(OC)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.724
InChIKey:ODDRBLGSTJSUEV-UHFFFAOYSA-N
ID: 109591
SMILES:c1c2ccc(O)c1-c1c(cc(CCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -14.348
InChIKey:HDQXPQZGJFYNKT-UHFFFAOYSA-N
ID: 109592
SMILES:CC(=CCCC(=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 109593
SMILES:C1(C)(C)Oc2c(c(O)cc(C)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 109594
SMILES:c1(CC=C(C)CC(C=C(CCC(C(=C)C)O)C)=C)c(O)c(OC)c(C)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.754
CB1 binding score: -15.102
InChIKey:UASBCKQOSMORHA-UHFFFAOYSA-N
ID: 109595
SMILES:C1C(C(=C)C)C(C(CC(C)=CCc2c(O)c(C)cc(O)c2)=C)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -16.091
InChIKey:OLTFKHOHCWHFKL-UHFFFAOYSA-N
ID: 109596
SMILES:C(CC(=CC1C=C(C)C(CC(=CCc2c(O)c(C)cc(O)c2)C)C1)C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.25
InChIKey:LUTOKTSKMUAHAM-UHFFFAOYSA-N
ID: 109597
SMILES:C(c1c(Br)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.419
CB1 binding score: Not available
InChIKey:WKEGXWDETXJAKG-UHFFFAOYSA-N
ID: 109598
SMILES:c1(OC)c(OC)c2c(cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.109
InChIKey:VBCMWGGQYWNKFK-UHFFFAOYSA-N
ID: 109599
SMILES:O=C(CCc1cc2c(c(O)c1C)C1C=C(C)CCC1C(C)(C)O2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.153
InChIKey:DCBWUJKFIGVSRD-UHFFFAOYSA-N