ID: 80473
SMILES:C1C2C(C)(CCC)C13C(C(C)(C)C)CCC2(C)Oc1c3cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.379
InChIKey:SHMQZLTWVKTWQZ-UHFFFAOYSA-N
ID: 80474
SMILES:OC12CC3c4c(cc(CCCCC)cc4O1)OC(C)(C)C3CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.26
InChIKey:AUOVKUYRHXQZJC-UHFFFAOYSA-N
ID: 80475
SMILES:Oc1cc(C)c2c(c1CCCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.74
InChIKey:DGLXYMNASRAEPD-UHFFFAOYSA-N
ID: 80476
SMILES:c1(O)cc(CCCCC)c(C(O)=O)c(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 80477
SMILES:c1(OC)c(C2C=C(C)CCC2C(=C)C)c(O)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.189
InChIKey:XIKSPZHKWNEGGO-UHFFFAOYSA-N
ID: 80478
SMILES:c12c(O)c3c(cc1OC(C)(C)C1CCC(C)=CC21)OC(O)C3(C)Oc1cc(O)c(CC=C(C)CCC=C(C)C)c(OC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.757
CB1 binding score: -16.654
InChIKey:MKJFTWHVQPNAMJ-UHFFFAOYSA-N
ID: 80479
SMILES:C(CC)CCCc1cc2c(c(O)c1C=O)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.85
InChIKey:BIQOARJNEHDPOC-UHFFFAOYSA-N
ID: 80480
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 80481
SMILES:O=C(C)Oc1cc2c(cc1CCCCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.754
InChIKey:RUUUGVDMBCHQLS-UHFFFAOYSA-N
ID: 80482
SMILES:CCCCCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 80483
SMILES:c12c(cc(OC)cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.687
InChIKey:UHTAHYZTMUZEEI-UHFFFAOYSA-N
ID: 80484
SMILES:C12C(C(C)(C)Oc3cc(CCCCCC)cc(O)c31)CC(CCC)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -11.814
InChIKey:NUOJVQOPDMNILM-UHFFFAOYSA-N
ID: 80485
SMILES:C(CCc1cc2c(c(O)c1)-c1c(ccc(C)c1)C(C)(C)O2)(O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.365
CB1 binding score: -17.558
InChIKey:CVNAHYHPXGQGFL-UHFFFAOYSA-N
ID: 80486
SMILES:C12(CC=C(CO)CC1)C(C)(C)Oc1c2c(O)cc(CCCCCO)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.521
InChIKey:WAYOYBMMJSZJJR-UHFFFAOYSA-N
ID: 80487
SMILES:C12C(COc3cc(CCCCC)cc(O)c31)C(CCC=C(C)C)(C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.477
InChIKey:BXQWBWDRRJSCGI-UHFFFAOYSA-N
ID: 80488
SMILES:CC(OCC1C(O)C(O)C(O)C(Oc2c(CC=C(CCC=C(C)C)C)cc(O)c(CC=C(C)C)c2)O1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.647
CB1 binding score: -13.361
InChIKey:IINZXKNKNAGXKJ-UHFFFAOYSA-N
ID: 80489
SMILES:Oc1cc(CCCCC)cc2c1C1CC(=C(C=O)C)C(C=CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -16.015
InChIKey:ANBZKJOELLIFQR-UHFFFAOYSA-N
ID: 80490
SMILES:CC1=CCCC(C)=CCCC2(C)C(C)(C1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -13.275
InChIKey:SEBGQVQJNOBZFR-UHFFFAOYSA-N
ID: 80491
SMILES:C1(O)(C)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 80492
SMILES:O(C(=O)c1c(OC)c2c(cc1)OC(C)(C)C1CC=C(C)CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.314
InChIKey:DLCDEIROEBJKEO-UHFFFAOYSA-N
ID: 80493
SMILES:c1(CC=C(C)CCC=C(C)C)cc(CCCCC)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.441
InChIKey:VPIIPBDTVZXIEC-UHFFFAOYSA-N